ethyl (1R,3R,5S)-3-oxidanyl-1-phenyl-8-azabicyclo[3.2.1]octane-5-carboxylate

Systemtic Name: ethyl (1R,3R,5S)-3-oxidanyl-1-phenyl-8-azabicyclo[3.2.1]octane-5-carboxylate Openeye Name: ethyl (1R,3R,5S)-3-hydroxy-1-phenyl-8-azabicyclo[3.2.1]octane-5-carboxylate CAS Name: (1R,3R,5S)-3-hydroxy-1-phenyl-8-azabicyclo[3.2.1]octane-5-carboxylic acid ethyl ester IUPAC Name: ethyl (1R,3R,5S)-3-hydroxy-1-phenyl-8-azabicyclo[3.2.1]octane-5-carboxylate Traditional Name: (1R,3R,5S)-3-hydroxy-1-phenyl-8-azabicyclo[3.2.1]octane-5-carboxylic acid ethyl ester Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C12CCC(N1)(CC(C2)O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)[C@@]12CC[C@@](N1)(C[C@H](C2)O)C3=CC=CC=C3

InChI

InChI=1S/C16H21NO3/c1-2-20-14(19)16-9-8-15(17-16,10-13(18)11-16)12-6-4-3-5-7-12/h3-7,13,17-18H,2,8-11H2,1H3/t13-,15-,16+/m1/s1